SCHEMBL8374273

SCHEMBL8374273

CC(C)(C)OC(=O)OC(=O)c1cc(Br)cc(Br)c1OC(=O)c1cc(C(=O)Oc2c(Br)cc(Br)cc2C(=O)OC(=O)OC(C)(C)C)cc(C(=O)Oc2c(Br)cc(Br)cc2C(=O)OC(=O)OC(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.39
▸ ELANE P08246 1/20 0.33
▸ NOTUM Q6P988 1/20 0.31
▸ AKR1C4 P17516 1/20 0.30
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ AKR1C1 Q04828 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ ALOX12 P18054 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8372308 0.76 HSD17B10 (0.59) HSD17B10ELANEAKR1C4AKR1C3AKR1C2
SCHEMBL8375398 0.75 HSD17B10 (0.62) HSD17B10AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL8044565 0.72 HSD17B10 (0.57) HSD17B10AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL7595533 0.69 NOTUM (0.47) ELANENOTUMALOX15
SCHEMBL9174491 0.69 HSD17B10 (0.43) HSD17B10NOTUMAKR1C4AKR1C3AKR1C2
SCHEMBL31668173 0.66 AKR1C4 (0.55) HSD17B10AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL8055911 0.66 AKR1C4 (0.55) HSD17B10AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL3070779 0.66 NOTUM (0.47) ELANENOTUMALOX15
SCHEMBL9173276 0.66 HTT (0.47) HSD17B10
SCHEMBL21824325 0.65 TPMT (0.50) HSD17B10ELANE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0669940-B1 SPECIFICALLY CROSSLINKED HEMOGLOBIN WITH FREE FUNCTIONALITY UNIV TORONTO (CA) 1999-02-10 — — EP disclosed
US-5399671-A Specifically crosslinked hemoglobin with free functionality UNIVERSITY OF TORONTO INNOVATIONS FOUNDATION, THE (CA) 1995-03-21 — — US disclosed
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